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5-(4-tert-Butyl-phenoxymethyl)-4-p-tolyl-2,4-dihydro-[1,2,4]triazole-3-thione
SpectraBase Compound ID DPiWIkWfpoy
InChI InChI=1S/C20H23N3OS/c1-14-5-9-16(10-6-14)23-18(21-22-19(23)25)13-24-17-11-7-15(8-12-17)20(2,3)4/h5-12H,13H2,1-4H3,(H,22,25)
InChIKey VSVUKVPYXXCBJU-UHFFFAOYSA-N
Mol Weight 353.48 g/mol
Molecular Formula C20H23N3OS
Exact Mass 353.156184 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CB7EGuN2Hyk
Name 5-(4-tert-Butyl-phenoxymethyl)-4-p-tolyl-2,4-dihydro-[1,2,4]triazole-3-thione
Alternate Name(s) 3-[(4-tert-butylphenoxy)methyl]-4-(4-methylphenyl)-1H-1,2,4-triazole-5-thione 3-[(4-tert-butylphenoxy)methyl]-4-(p-tolyl)-1H-1,2,4-triazole-5-thione 5-[(4-tert-Butylphenoxy)methyl]-4-(4-methylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23N3OS
InChI InChI=1S/C20H23N3OS/c1-14-5-9-16(10-6-14)23-18(21-22-19(23)25)13-24-17-11-7-15(8-12-17)20(2,3)4/h5-12H,13H2,1-4H3,(H,22,25)
InChIKey VSVUKVPYXXCBJU-UHFFFAOYSA-N
Molecular Weight 353.484 g/mol
SMILES N1N=C(N(C1=S)c1ccc(cc1)C)COc1ccc(C(C)(C)C)cc1
SPLASH splash10-0udr-3910000000-63662f3deb1f2edd4bbd
Wiley ID 1463266